Glycoside
GD050572
Name:
NoneFormula:
C13H15O4N5Smiles:
C#CCNc1ncnc2c1ncn2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
C#CCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 305.29 | Num_heavy_atoms: | 22 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD08498
Formula: C8H6N5
Smiles:
C#CCNc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 172.17 | Num_heavy_atoms: | 13 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
